4-chloranyl-5-[[(2R)-4-methyl-2-morpholin-4-ium-4-yl-pentyl]amino]-2-phenyl-pyridazin-3-one

Systemtic Name: 4-chloranyl-5-[[(2R)-4-methyl-2-morpholin-4-ium-4-yl-pentyl]amino]-2-phenyl-pyridazin-3-one Openeye Name: 4-chloro-5-[[(2R)-4-methyl-2-morpholin-4-ium-4-yl-pentyl]amino]-2-phenyl-pyridazin-3-one CAS Name: 4-chloro-5-[[(2R)-4-methyl-2-(4-morpholin-4-iumyl)pentyl]amino]-2-phenyl-3-pyridazinone IUPAC Name: 4-chloro-5-[[(2R)-4-methyl-2-morpholin-4-ium-4-ylpentyl]amino]-2-phenylpyridazin-3-one Traditional Name: 4-chloro-5-[[(2R)-4-methyl-2-morpholin-4-ium-4-yl-pentyl]amino]-2-phenyl-pyridazin-3-one Formula: C20H28ClN4O2+ MolecularWeight: 391.91492

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(CNC1=C(C(=O)N(N=C1)C2=CC=CC=C2)Cl)[NH+]3CCOCC3

Isomeric SMILES

CC(C)C[C@H](CNC1=C(C(=O)N(N=C1)C2=CC=CC=C2)Cl)[NH+]3CCOCC3

InChI

InChI=1S/C20H27ClN4O2/c1-15(2)12-17(24-8-10-27-11-9-24)13-22-18-14-23-25(20(26)19(18)21)16-6-4-3-5-7-16/h3-7,14-15,17,22H,8-13H2,1-2H3/p+1/t17-/m1/s1